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4-(4-Methylbenzoyl)-1-n-butyl-5-tosylamino-1H-1,2,3-triazole
SpectraBase Compound ID GyTshw8joUK
InChI InChI=1S/C21H24N4O3S/c1-4-5-14-25-21(23-29(27,28)18-12-8-16(3)9-13-18)19(22-24-25)20(26)17-10-6-15(2)7-11-17/h6-13,23H,4-5,14H2,1-3H3
InChIKey HGBVDUBZVCLVGJ-UHFFFAOYSA-N
Mol Weight 412.51 g/mol
Molecular Formula C21H24N4O3S
Exact Mass 412.156912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GOkN2RA85x
Name 4-(4-Methylbenzoyl)-1-n-butyl-5-tosylamino-1H-1,2,3-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N4O3S
InChI InChI=1S/C21H24N4O3S/c1-4-5-14-25-21(23-29(27,28)18-12-8-16(3)9-13-18)19(22-24-25)20(26)17-10-6-15(2)7-11-17/h6-13,23H,4-5,14H2,1-3H3
InChIKey HGBVDUBZVCLVGJ-UHFFFAOYSA-N
Molecular Weight 412.508 g/mol
SMILES N(c1[n](nnc1C(c1ccc(cc1)C)=O)CCCC)S(=O)(=O)c1ccc(C)cc1
SPLASH splash10-08fr-0009600000-db311621950dda4768e1
Source of Spectrum SO-0-852-5
Synonyms N-[1-butyl-4-(4-methylbenzoyl)-1H-1,2,3-triazol-5-yl]-4-methylbenzenesulfonamide
Wiley ID 1540312